1-(2,4-Dinitrophenyl)pyridinium
TL;DR: 1-(2,4-Dinitrophenyl)pyridinium (CAS 46877-56-9) is a chemical compound with molecular formula C11H8N3O4+ and molecular weight 246.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dinitrophenyl)pyridin-1-ium
Also Known As: 1-(2,4-dinitrophenyl)pyridinium, pyridinium, 1-(2,4-dinitrophenyl)-, 1-(2,4-dinitrophenyl)pyridin-1-ium, (2,4-dinitrophenyl)pyridine, N-<2,4-Dinitro-phenyl>-pyridinium
| Molecular Formula | C11H8N3O4+ |
|---|---|
| Molecular Weight | 246.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 95.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.05148 |
| Heavy Atoms | 18 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 46877-56-9 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | MCNUBLFKORCVGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,4-Dinitrophenyl)pyridinium (CAS 46877-56-9), with molecular formula C11H8N3O4+ and molecular weight 246.05 g/mol. IUPAC: 1-(2,4-dinitrophenyl)pyridin-1-ium.
Chemical Property Profile of 1-(2,4-Dinitrophenyl)pyridinium
Property Insights of 1-(2,4-Dinitrophenyl)pyridinium
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,4-Dinitrophenyl)pyridinium. The TPSA of 95.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dinitrophenyl)pyridinium. Following Lipinski's Rule of Five, 1-(2,4-Dinitrophenyl)pyridinium has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,4-Dinitrophenyl)pyridinium?
The CAS number of 1-(2,4-Dinitrophenyl)pyridinium is 46877-56-9.
What is the molecular formula of 1-(2,4-Dinitrophenyl)pyridinium?
The molecular formula of 1-(2,4-Dinitrophenyl)pyridinium is C11H8N3O4+.
What is the molecular weight of 1-(2,4-Dinitrophenyl)pyridinium?
The molecular weight of 1-(2,4-Dinitrophenyl)pyridinium is 246.05 g/mol.
Where can I buy 1-(2,4-Dinitrophenyl)pyridinium?
You can request a quote for 1-(2,4-Dinitrophenyl)pyridinium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-Dinitrophenyl)pyridinium?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dinitrophenyl)pyridinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.